2-amino-1-[(3-methoxyphenyl)methyl]-4,5-dimethyl-1H-pyrrole-3-carbonitrile
Chemical Structure Depiction of
2-amino-1-[(3-methoxyphenyl)methyl]-4,5-dimethyl-1H-pyrrole-3-carbonitrile
2-amino-1-[(3-methoxyphenyl)methyl]-4,5-dimethyl-1H-pyrrole-3-carbonitrile
Compound characteristics
| Compound ID: | 8018-7416 |
| Compound Name: | 2-amino-1-[(3-methoxyphenyl)methyl]-4,5-dimethyl-1H-pyrrole-3-carbonitrile |
| Molecular Weight: | 255.32 |
| Molecular Formula: | C15 H17 N3 O |
| Smiles: | Cc1c(C#N)c(N)n(Cc2cccc(c2)OC)c1C |
| Stereo: | ACHIRAL |
| logP: | 2.5586 |
| logD: | 2.5586 |
| logSw: | -2.6177 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.787 |
| InChI Key: | HCRKNYVGNARRFE-UHFFFAOYSA-N |